CID 2783607

6-chloro-2-methylpyridazin-3(2h)-one

Structural Information

Molecular Formula

C₅H₅ClN₂O

SMILES

CN1C(=O)C=CC(=N1)Cl

InChI

InChI=1S/C5H5ClN2O/c1-8-5(9)3-2-4(6)7-8/h2-3H,1H3

InChIKey

IMBNTYIRTCQBRJ-UHFFFAOYSA-N

Compound name

6-chloro-2-methylpyridazin-3-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 279
Patents: 144.00903 Da
Monoisotopic Mass: 0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	145.01631	122.5
[M+Na]+	166.99825	138.0
[M+NH4]+	162.04285	131.1
[M+K]+	182.97219	131.3
[M-H]-	143.00175	123.7
[M+Na-2H]-	164.98370	130.6
[M]+	144.00848	125.3
[M]-	144.00958	125.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe